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Density of states of DNA molecules with varied itinerant electrons

✍ Scribed by J. Song; D.C. Zhang; D.S. Liu; L.M. Mei; S.J. Xie


Book ID
116897883
Publisher
Elsevier Science
Year
2005
Tongue
English
Weight
205 KB
Volume
155
Category
Article
ISSN
0379-6779

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A new method for calculating the ground state electron density of interacting molecules is presented. The supermolecule electron density is obtained using an iterative procedure. At each step the electron density of one molecule is calculated using previously introduced Kohn-Sham equations with cons